%chk=000224704.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224704

0 1
S 5.530656 -1.773686 0.010056
S -5.530620 1.773716 0.009731
O 4.215354 -0.714970 0.009939
O -4.215319 0.715000 0.009854
O 5.458995 -2.495683 -1.237429
O 5.458757 -2.495688 1.257528
O -5.458926 2.495467 -1.237895
O -5.458751 2.495965 1.257063
C 0.482821 -0.596370 0.010135
C -0.482785 0.596399 0.010024
C 1.940912 -0.126814 0.009982
C -1.940877 0.126842 0.009983
C 2.901108 -1.316594 0.010083
C -2.901072 1.316623 0.009858
C 6.806735 -0.633011 0.010179
C -6.806699 0.633042 0.010049
C 7.329451 -0.164563 -1.202122
C -7.329386 0.164357 -1.202176
C 7.329354 -0.164734 1.222607
C -7.329348 0.165004 1.222553
C 8.890150 1.243282 0.010395
C -8.890119 -1.243244 0.010582
C 8.365913 0.767484 -1.205042
C -8.365848 -0.767686 -1.204939
C 8.365801 0.767299 1.225741
C -8.365801 -0.767027 1.225844
C 10.006787 2.231479 0.010665
C -10.006761 -2.231436 0.010968
H 0.289991 -1.235489 0.894493
H 0.289887 -1.235747 -0.874014
H -0.289862 1.235602 -0.874252
H -0.289943 1.235691 0.894254
H 2.150141 0.513549 0.890499
H 2.150036 0.513312 -0.870731
H -2.150095 -0.513345 0.890630
H -2.150011 -0.513459 -0.870600
H 2.799975 -1.939312 0.918892
H 2.799880 -1.939539 -0.898558
H -2.799927 1.939523 0.918540
H -2.799856 1.939385 -0.898910
H 6.928082 -0.535907 -2.152652
H -6.927993 0.535517 -2.152768
H 6.927895 -0.536223 2.173043
H -6.927916 0.536680 2.172927
H 8.769339 1.126385 -2.150351
H -8.769257 -1.126772 -2.150184
H 8.769179 1.126084 2.171115
H -8.769201 -1.125620 2.171282
H 10.981217 1.716806 0.015062
H 9.994141 2.883733 -0.874100
H 9.988854 2.888801 0.891607
H -10.981192 -1.716755 0.013830
H -9.993258 -2.884699 -0.873044
H -9.989688 -2.887753 0.892672


%chk=000224704-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224704

0 1
S 5.717234 -1.814201 0.012024
S -5.717198 1.814233 0.011854
O 4.319276 -0.572023 0.011501
O -4.319241 0.572054 0.011465
O 5.685960 -2.624233 -1.392794
O 5.687022 -2.621836 1.418244
O -5.685927 2.624117 -1.393051
O -5.686982 2.622016 1.417988
C 0.514713 -0.576598 0.012219
C -0.514679 0.576628 0.011879
C 1.973485 -0.059419 0.011753
C -1.973450 0.059449 0.011905
C 2.981612 -1.217330 0.012327
C -2.981577 1.217360 0.011940
C 7.112194 -0.568242 0.010412
C -7.112160 0.568275 0.010374
C 7.610425 -0.134970 -1.227995
C -7.610386 0.134871 -1.227994
C 7.611136 -0.132479 1.247691
C -7.611107 0.132646 1.247693
C 9.218899 1.270485 0.007970
C -9.218867 -1.270449 0.008115
C 8.674092 0.793079 -1.214144
C -8.674050 -0.793171 -1.214051
C 8.674756 0.795528 1.231375
C -8.674733 -0.795366 1.231468
C 10.382346 2.244255 0.006779
C -10.382317 -2.244216 0.006983
H 0.346518 -1.217584 0.901693
H 0.346250 -1.218358 -0.876647
H -0.346303 1.217784 -0.877437
H -0.346396 1.218217 0.900903
H 2.151635 0.573133 0.901984
H 2.151424 0.572057 -0.879284
H -2.151488 -0.572591 0.902522
H -2.151503 -0.572539 -0.878747
H 2.869866 -1.844688 0.918372
H 2.869401 -1.845995 -0.892756
H -2.869802 1.845159 0.917678
H -2.869394 1.845585 -0.893450
H 7.190939 -0.518585 -2.163257
H -7.190894 0.518389 -2.163292
H 7.192180 -0.514223 2.183954
H -7.192156 0.514485 2.183920
H 9.084012 1.151754 -2.165006
H -9.083967 -1.151946 -2.164878
H 9.085214 1.156125 2.181286
H -9.085194 -1.155864 2.181414
H 11.347180 1.701087 0.012091
H 10.373428 2.887506 -0.889979
H 10.368355 2.895659 0.897608
H -11.347153 -1.701038 0.010631
H -10.372508 -2.888574 -0.888977
H -10.369217 -2.894519 0.898622


